Potassium Cation → Methyl 2-[4-((2,3-dihydro[1,4]dioxino[2,3-c]pyridin-7-ylmethyl){[(1,1-dimethylethyl)oxy]carbonyl}amino)-1-piperidinyl]-3-[(phenylmethyl)oxy]propanoate

HRID 2313385Notes

Reaction equation

HRID 2313385 reaction equation
[Br:26][CH:27]([C:28](=[O:29])[O:30][CH3:31])[CH2:32][O:33][CH2:34][c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1.[C:41](=[O:42])([O-:43])[O-:44].[K+:45].[K+:46].[O:1]1[CH2:2][CH2:3][O:4][c:5]2[cH:6][n:7][c:8]([CH2:11][N:12]([C:13]([O:14][C:15]([CH3:16])([CH3:17])[CH3:18])=[O:19])[CH:20]3[CH2:21][CH2:22][NH:23][CH2:24][CH2:25]3)[cH:9][c:10]21.[O:47]=[CH:48][N:49]([CH3:50])[CH3:51]>>[O:1]1[CH2:2][CH2:3][O:4][c:5]2[cH:6][n:7][c:8]([CH2:11][N:12]([C:13]([O:14][C:15]([CH3:16])([CH3:17])[CH3:18])=[O:19])[CH:20]3[CH2:21][CH2:22][N:23]([CH:27]([C:28](=[O:29])[O:30][CH3:31])[CH2:32][O:33][CH2:34][c:35]4[cH:36][cH:37][cH:38][cH:39][cH:40]4)[CH2:24][CH2:25]3)[cH:9][c:10]21

Participants

6

Reactant 5

HCID 813Potassium Cation2×HCID 6228DimethylformamideHCID 19660Carbonate IonHCID 11011152Propanoic acid, 2-bromo-3-(phenylmethoxy)-, methyl esterHCID 578154611,1-Dimethylethyl (2,3-dihydro[1,4]dioxino[2,3-c]pyridin-7-ylmethyl)-4-piperidinylcarbamate

Product 1

HCID 68597436Methyl 2-[4-((2,3-dihydro[1,4]dioxino[2,3-c]pyridin-7-ylmethyl){[(1,1-dimethylethyl)oxy]carbonyl}amino)-1-piperidinyl]-3-[(phenylmethyl)oxy]propanoate

Sources & evidence

ORD record
ord-79f5dc4df1fa434e9be280e1347ff889
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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